2-hydroxyethyl-methyl-bis[5-oxidanyl-4-(2-propoxyethyl)tridecyl]azanium

Systemtic Name: 2-hydroxyethyl-methyl-bis[5-oxidanyl-4-(2-propoxyethyl)tridecyl]azanium Openeye Name: 2-hydroxyethyl-bis[5-hydroxy-4-(2-propoxyethyl)tridecyl]-methyl-ammonium CAS Name: 2-hydroxyethyl-bis[5-hydroxy-4-(2-propoxyethyl)tridecyl]-methylammonium IUPAC Name: 2-hydroxyethyl-bis[5-hydroxy-4-(2-propoxyethyl)tridecyl]-methylazanium Traditional Name: 2-hydroxyethyl-bis[5-hydroxy-4-(2-propoxyethyl)tridecyl]-methyl-ammonium Formula: C39H82NO5+ MolecularWeight: 645.07208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCC[N+](C)(CCCC(CCOCCC)C(CCCCCCCC)O)CCO)CCOCCC)O

Isomeric SMILES

CCCCCCCCC(C(CCC[N+](C)(CCCC(CCOCCC)C(CCCCCCCC)O)CCO)CCOCCC)O

InChI

InChI=1S/C39H82NO5/c1-6-10-12-14-16-18-24-38(42)36(26-34-44-32-8-3)22-20-28-40(5,30-31-41)29-21-23-37(27-35-45-33-9-4)39(43)25-19-17-15-13-11-7-2/h36-39,41-43H,6-35H2,1-5H3/q+1